Chem
J-GLOBAL ID：200907097361607337   Nikkaji number：J24.834G

2-Methylbutyric acid 8-[2-(4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl ester

8-[2-(4-ヒドロキシ-6-オキソオキサン-2-イル)エチル]-7-メチル-1,2,3,7,8,8a-ヘキサヒドロナフタレン-1-イル 2-メチルブタノアート
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C23H34O5
Molecular formula furigana： C23-H34-O5
Molecular weight： 390.520
InChI： InChI=1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3
InChI key： AJLFOPYRIVGYMJ-UHFFFAOYSA-N
SMILES： CCC(C)C(=O)OC1CCC=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C12
Systematic name  (3)：
  • 2-メチル酪酸8-[2-(4-ヒドロキシ-6-オキソテトラヒドロ-2H-ピラン-2-イル)エチル]-7-メチル-1,2,3,7,8,8a-ヘキサヒドロナフタレン-1-イル
  • 8-[2-(4-ヒドロキシ-6-オキソオキサン-2-イル)エチル]-7-メチル-1,2,3,7,8,8a-ヘキサヒドロナフタレン-1-イル 2-メチルブタノアート
  • 8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2-methylbutanoate
Other name (1)：
  • 2-Methylbutyric acid 8-[2-(4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl ester
CAS registry number： 58948-09-7
Regulation number (1)：
  • 8-(4)-914
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